AMBER Archive (2009)

Subject: [AMBER] atom numbers

From: Vikas Sharma (vs_vikassharma_at_yahoo.co.in)
Date: Tue Apr 21 2009 - 06:12:27 CDT

Dear all,

i am working on MM PBSA..
when i try to load the protein-ligand complex PDB, it gives the warning that "atom numbers should be unique....."

I have found out the atom numbers which have no number in the pdb file... the same atoms dont have atom number in mol2 file of the ligand..

how can i number those atoms...
helppp

thanks

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